10-Hydroxy-11-prop-1-enyl-3,5,12-trioxa-7-azatricyclo[6.4.0.02,6]dodeca-1(8),2(6),10-trien-9-one
| Internal ID | 4f185ee0-8550-4237-aec4-d39403b30245 |
| Taxonomy | Organoheterocyclic compounds > Pyrans > Pyranones and derivatives |
| IUPAC Name | 10-hydroxy-11-prop-1-enyl-3,5,12-trioxa-7-azatricyclo[6.4.0.02,6]dodeca-1(8),2(6),10-trien-9-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C11H9NO5/c1-2-3-5-7(13)8(14)6-9(17-5)10-11(12-6)16-4-15-10/h2-3,12-13H,4H2,1H3 |
| InChI Key | CYHGDBJCXMTRFL-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C11H9NO5 |
| Molecular Weight | 235.19 g/mol |
| Exact Mass | 235.04807239 g/mol |
| Topological Polar Surface Area (TPSA) | 80.80 Ų |
| XlogP | 1.70 |
| There are no found synonyms. |
![2D Structure of 10-Hydroxy-11-prop-1-enyl-3,5,12-trioxa-7-azatricyclo[6.4.0.02,6]dodeca-1(8),2(6),10-trien-9-one](https://plantaedb.com/storage/docs/compounds/2023/11/10-hydroxy-11-prop-1-enyl-3512-trioxa-7-azatricyclo640026dodeca-182610-trien-9-one.jpg "2D Structure of 10-Hydroxy-11-prop-1-enyl-3,5,12-trioxa-7-azatricyclo[6.4.0.02,6]dodeca-1(8),2(6),10-trien-9-one")
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 98.30% | 91.11% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 94.75% | 94.45% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 94.65% | 89.34% |
| CHEMBL2581 | P07339 | Cathepsin D | 92.95% | 98.95% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 92.30% | 95.56% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 88.54% | 89.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 87.67% | 99.23% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 85.63% | 94.73% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 84.39% | 96.77% |
| CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 80.15% | 91.71% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
| There are no matching plants. |
| PubChem | 72819747 |
| LOTUS | LTS0210449 |
| wikiData | Q104972301 |